(diphenylmethyl) 6-(1-bromanylpropan-2-yl)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Systemtic Name: (diphenylmethyl) 6-(1-bromanylpropan-2-yl)-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Openeye Name: benzhydryl 6-(2-bromo-1-methyl-ethyl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate CAS Name: 6-(1-bromopropan-2-yl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 6-(1-bromopropan-2-yl)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate Traditional Name: 6-(2-bromo-1-methyl-ethyl)-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid benzhydryl ester Formula: C24H26BrNO3S MolecularWeight: 488.43714

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Descriptors Computed from Structure

Canonical SMILES:

CC(CBr)C1C2N(C1=O)C(C(S2)(C)C)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(CBr)C1C2N(C1=O)C(C(S2)(C)C)C(=O)OC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H26BrNO3S/c1-15(14-25)18-21(27)26-20(24(2,3)30-22(18)26)23(28)29-19(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h4-13,15,18-20,22H,14H2,1-3H3